Roshan Shrestha's repositories
AmberMdPrep
Wrapper script for preparing explicitly solvated systems for molecular dynamics simulations with Amber.
awesome-cheatsheets
👩💻👨💻 Awesome cheatsheets for popular programming languages, frameworks and development tools. They include everything you should know in one single file.
molmod
MolMod is a collection of molecular modelling tools for python.
practical_cheminformatics_tutorials
Practical Cheminformatics Tutorials
ITP_builder
ITP builder for Nanomaterial
cplusplus
Codecademy course on C++
youtube_channel
Notebooks for the python tutorials of my youtube channel. See specific youtube video for link to specifc notebook.
Tutorials_CP2K
Tutorials on CP2K calculations
Building-Models
Building AA/CG models for nanomaterials
vector-fields
Artistic visualization of vector fields created with Matplotlib and Jupyter Notebook
GO_atomistic
AA simulations of GO
academicpages.github.io
Github Pages template for academic personal websites, forked from mmistakes/minimal-mistakes
nano281
Data Science for Materials Science
openmm-tutorial-msbs
OpenMM tutorial for the MSBS course
ProgrammingProjects
C++ Programming Tutorial in Chemistry
python-workshop
Tutorials I delivered during the workshop
molssi-mm-synthesis
Final activity for MolSSI MM Tools workshop
github-tutorial
Set up for the MolSSi MM Tools Workshop
ipywidgets
Doing cool science presentations with ipywidgets
Learn-JavaScript
Codecademy's course on Learning JavaScript
numpy-100
100 numpy exercises (with solutions)
Data-Fitting
Practicing fitting data